(4-butoxyphenyl)methyl-[(2R)-5-methylhexan-2-yl]azanium

Systemtic Name: (4-butoxyphenyl)methyl-[(2R)-5-methylhexan-2-yl]azanium Openeye Name: (4-butoxyphenyl)methyl-[(1R)-1,4-dimethylpentyl]ammonium CAS Name: (4-butoxyphenyl)methyl-[(2R)-5-methylhexan-2-yl]ammonium IUPAC Name: (4-butoxyphenyl)methyl-[(2R)-5-methylhexan-2-yl]azanium Traditional Name: (4-butoxybenzyl)-[(1R)-1,4-dimethylpentyl]ammonium Formula: C18H32NO+ MolecularWeight: 278.45278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C[NH2+]C(C)CCC(C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C[NH2+][C@H](C)CCC(C)C

InChI

InChI=1S/C18H31NO/c1-5-6-13-20-18-11-9-17(10-12-18)14-19-16(4)8-7-15(2)3/h9-12,15-16,19H,5-8,13-14H2,1-4H3/p+1/t16-/m1/s1